DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-

Base Information

Chemical Name:DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-
CAS No.:119858-72-9
Molecular Formula:C₂₀H₂₃N₃O₅
Molecular Weight:385.42
Hs Code.:
Wikidata:Q76389681

Synonyms:BRN 5646170;DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-;119858-72-9;LS-105786

Suppliers and Price of DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.213g/cm³
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:9
Exact Mass:385.16377084
Heavy Atom Count:28
Complexity:536

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=NC(=N1)OC)OC)C=CC(=O)NC(CC2=CC=CC=C2)C(=O)OC
Isomeric SMILES:CC1=C(C(=NC(=N1)OC)OC)/C=C/C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

Technology Process of DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)-

There total 3 articles about DL-Phenylalanine, N-(3-(2,4-dimethoxy-6-methyl-5-pyrimidinyl)-1-oxo-2-propenyl)-, methyl ester, (E)- which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 119840-20-9
ethyl (E)-3-(2,4-dichloro-6-methyl-5-pyrimidinyl)-2-propenoate

: 119858-72-9
2-[(E)-3-(2,4-Dimethoxy-6-methyl-pyrimidin-5-yl)-acryloylamino]-3-phenyl-propionic acid methyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 74.4 percent / 5 N aq. NaOH / 5 h

2: 1.) isobutyl chlorocarbonate, triethylamine, 2.) triethylamine / 1.) CH₃CN, 10 min, 2.) CH₃CN, room temp., overnight

With sodium hydroxide; triethylamine; isobutyl chloroformate;
DOI:10.1007/BF00763666

Reference yield:

: 28277-68-1
Ethyl (E)-3-(2,4-Dioxo-6-methyl-5-pyrimidinyl)acrylate

: 119858-72-9
2-[(E)-3-(2,4-Dimethoxy-6-methyl-pyrimidin-5-yl)-acryloylamino]-3-phenyl-propionic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 83 percent / POCl₃, diethylaniline / 20 h / 90 °C

2: 74.4 percent / 5 N aq. NaOH / 5 h

3: 1.) isobutyl chlorocarbonate, triethylamine, 2.) triethylamine / 1.) CH₃CN, 10 min, 2.) CH₃CN, room temp., overnight

With sodium hydroxide; triethylamine; N,N-diethylaniline; trichlorophosphate; isobutyl chloroformate;
DOI:10.1007/BF00763666

Reference yield:

: 15028-44-1
DL-phenylalanine methyl ester

: 119840-21-0
(E)-β-(2,4-dimethoxy-6-methylpyrimidin-5-yl)acrylic acid

: 119858-72-9
2-[(E)-3-(2,4-Dimethoxy-6-methyl-pyrimidin-5-yl)-acryloylamino]-3-phenyl-propionic acid methyl ester

Guidance literature:: With triethylamine; isobutyl chloroformate; Yield given. Multistep reaction; 1.) CH₃CN, 10 min, 2.) CH₃CN, room temp., overnight;
DOI:10.1007/BF00763666